[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone

C15H22N4O2 — CID 56778579

IUPAC[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone
SMILESCc1ccc(NC2CCN(C(=O)C3CCCO3)CC2)nn1
InChIInChI=1S/C15H22N4O2/c1-11-4-5-14(18-17-11)16-12-6-8-19(9-7-12)15(20)13-3-2-10-21-13/h4-5,12-13H,2-3,6-10H2,1H3,(H,16,18)
InChIKeyGSYYAXCOYQMBEH-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.37
Rot. Bonds3

About [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone

[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone (PubChem CID 56778579) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone.

Molecular Properties

Compound Name[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone
PubChem CID56778579
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone
SMILESCc1ccc(NC2CCN(C(=O)C3CCCO3)CC2)nn1
InChIInChI=1S/C15H22N4O2/c1-11-4-5-14(18-17-11)16-12-6-8-19(9-7-12)15(20)13-3-2-10-21-13/h4-5,12-13H,2-3,6-10H2,1H3,(H,16,18)
InChIKeyGSYYAXCOYQMBEH-UHFFFAOYSA-N
XLogP1.37
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-3-yl)methanone
CID 56778602
[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-pyridin-4-ylmethanone
CID 56778575
(2S)-1-[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-2-[[(2S)-oxolan-2-yl]methoxy]propan-1-one
CID 95339500
(5-methylpyrazin-2-yl)-[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]methanone
CID 56778576
N-(2,6-dimethyl-3-pyridinyl)-4-(oxolane-2-carbonyl)piperazine-1-carboxamide
CID 146091914
[1-(oxolane-2-carbonyl)piperidin-4-yl]carbamic acid
CID 156534121
[4-[3-[(5-methyl-2-pyridinyl)amino]propylamino]piperidin-1-yl]-(oxolan-2-yl)methanone
CID 131898169
3-methyl-N-[1-[(2R)-oxolane-2-carbonyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide
CID 94797390
4-methyl-N-[1-[(2R)-oxolane-2-carbonyl]piperidin-4-yl]benzenesulfonamide
CID 94091179
[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 56778589
[4-(5-methylpyrazine-2-carbonyl)piperazin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 94150695
3-methyl-N-[1-(oxolane-2-carbonyl)piperidin-4-yl]benzamide
CID 110819733

Frequently Asked Questions

What is the IUPAC name of [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone?
The IUPAC name of [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone (CID 56778579) is [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone.
What is the SMILES notation for [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone?
The canonical SMILES for [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone is Cc1ccc(NC2CCN(C(=O)C3CCCO3)CC2)nn1.
What is the InChIKey of [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone?
The InChIKey is GSYYAXCOYQMBEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-11-4-5-14(18-17-11)16-12-6-8-19(9-7-12)15(20)13-3-2-10-21-13/h4-5,12-13H,2-3,6-10H2,1H3,(H,16,18).
What are the key properties of [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone?
[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone has a molecular weight of 290.37 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-(oxolan-2-yl)methanone is sourced from PubChem (CID 56778579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).